Basic information
- CAS
21074-52-2- Standard SMILES
C[N+](C)(C)CCC[n+]1ccc(C=Cc2ccccc2)cc1.[Br-].[Br-]- InChIKey
PPNGBUNXPYHPHB-UHFFFAOYSA-L- Molecular formula
- C19H26Br2N2
- Average molar mass
- 442.2 g/mol
- Monoisotopic mass
- 440.04627
Names & identifiers
- Preferred name
- Pyridinium, 4-styryl-1-(3-(trimethylammonio)propyl)-, dibromide
- IUPAC
- trimethyl-[3-[4-(2-phenylethenyl)pyridin-1-ium-1-yl]propyl]azanium dibromide
Names & synonyms
21074-52-24-Styryl-1-(3-(trimethylammonio)propyl)pyridinium dibromidePyridinium, 4-styryl-1-(3-(trimethylammonio)propyl)-, dibromide1-(3-Dimethylaminopropyl)-4-styryl pyridinium bromide methobromidePyridinium, 1-(3'-dimethylaminopropyl)-4-styryl-, bromide, methobromideRefChem:377263DTXSID209433844-(2-Phenylethen-1-yl)-1-[3-(trimethylazaniumyl)propyl]pyridin-1-ium dibromide4-(2-Phenylethenyl)-1-[3-(trimethylazaniumyl)propyl]pyridin-1-ium dibromide
Database identifiers
- CAS
21074-52-2- PubChem CID
- 89426
- DTXSID
DTXSID20943384
Properties
Computed structural properties
- Topological polar surface area
- 3.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 302
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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